![N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide structure](/static/products/314/314765-63-4.png)
N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide
TL;DR: N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide (CAS 314765-63-4) is a chemical compound with molecular formula C19H20N4O7S and molecular weight 448.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dinitrobenzamide
Also Known As: N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide, BAS 01219107, N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dinitrobenzamide, AN-329/13319010, N-[4-(Azepane-1-sulfonyl)-phenyl]-3,5-dinitro-benzamide
| Molecular Formula | C19H20N4O7S |
|---|---|
| Molecular Weight | 448.11 g/mol |
| LogP | 3.32 |
| Topological Polar Surface Area | 152.76 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.10526 |
| Heavy Atoms | 31 |
| Complexity | 1076.3263 |
Chemical Identifiers
| CAS Number | 314765-63-4 |
|---|---|
| SMILES | C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide (CAS 314765-63-4), with molecular formula C19H20N4O7S and molecular weight 448.11 g/mol. IUPAC: N-[4-(azepan-1-ylsulfonyl)phenyl]-3,5-dinitrobenzamide.
Chemical Property Profile of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide
Property Insights of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide
The XLogP value of 3.32 indicates that N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 152.76 Ų indicates high polarity, suggesting N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide?
The CAS number of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide is 314765-63-4.
What is the molecular formula of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide?
The molecular formula of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide is C19H20N4O7S.
What is the molecular weight of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide?
The molecular weight of N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide is 448.11 g/mol.
Where can I buy N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide?
You can request a quote for N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-[4-(1-azepanylsulfonyl)phenyl]-3,5-dinitrobenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.